2-(2'-Chlorobenzyloxy)phenylboronic acid

• Catalog Number: ACM870777212
• Product Name: 2-(2'-Chlorobenzyloxy)phenylboronic acid
• CAS: 870777-21-2
• Category: Heterocyclic Organic Compound
• Synonyms: 2-(2-Chlorobenzyloxy)phenylboronic acid, 870777-21-2, 2-(2-Chlorobenzyloxy)phenylboronic acid, SureCN2554369, 639443_ALDRICH, CTK8B2498, MolPort-002-052-408, ANW-38459, AKOS009319100, AB23047, AK-45391, KB-13986, (2-((2-Chlorobenzyl)oxy)phenyl)boronic acid, I01-16381, (2-[(2-CHLOROPHENYL)METHOXY]PHENYL)BORONIC ACID, 2-(2 inverted exclamation marka-Chlorobenzyloxy)phenylboronic acid
• IUPAC Name: [2-[(2-chlorophenyl)methoxy]phenyl]boronic acid
• Molecular Weight: 262.5g/mol
• Molecular Formula: C13H12BClO3
• Canonical SMILES: B(C1=CC=CC=C1OCC2=CC=CC=C2Cl)(O)O
• InChI: InChI=1S/C13H12BClO3/c15-12-7-3-1-5-10(12)9-18-13-8-4-2-6-11(13)14(16)17/h1-8,16-17H,9H2
• InChI Key: OOORTTOHYXWCDV-UHFFFAOYSA-N
• Boiling Point: 454.8ºC at 760 mmHg
• Melting Point: 124-129ºC(lit.)
• Flash Point: 228.9ºC
• Density: 1.3g/cm³
• Complexity: 252
• Covalently-Bonded Unit Count: 1
• Exact Mass: 262.056802g/mol
• Formal Charge: 0
• H-Bond Acceptor: 3
• H-Bond Donor: 2
• Heavy Atom Count: 18
• Monoisotopic Mass: 262.056802g/mol
• Rotatable Bond Count: 4